List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
47752 |
10535101 |
3 |
OC3H4 |
AB3C4 |
-110.36 |
2.04 |
-9.62 |
-0.42 |
0 |
|
|
47753 |
10535113 |
2 |
OC5H8 |
AB5C8 |
-101.37 |
5.14 |
-10.59 |
-0.33 |
0 |
|
|
47754 |
10535115 |
2 |
OC5H8 |
AB5C8 |
-106.93 |
5.13 |
-9.54 |
0.3 |
0 |
|
|
47755 |
10535140 |
1 |
NO2C9H15 |
AB2C9D15 |
-88.08 |
2.7 |
-9.68 |
0.69 |
0 |
|
|
47756 |
10535149 |
2 |
O2C4H5 |
A2B4C5 |
-145.86 |
2.62 |
-10.78 |
0.44 |
0 |
|
|
47757 |
10535150 |
1 |
O3C9H14 |
A3B9C14 |
-127.89 |
4.0 |
-10.22 |
0.71 |
0 |
|
|
47758 |
10535151 |
1 |
O3C9H14 |
A3B9C14 |
-125.96 |
2.97 |
-10.1 |
0.21 |
0 |
|
|
47759 |
10535176 |
1 |
ClOF2C6H9 |
ABC2D6E9 |
-157.59 |
2.21 |
-10.19 |
-0.26 |
0 |
|
|
47760 |
10535177 |
1 |
NO4C7H9 |
AB4C7D9 |
-137.53 |
5.09 |
-9.93 |
-0.28 |
0 |
|
|
47761 |
10535178 |
1 |
FNO2C8H10 |
ABC2D8E10 |
-95.8 |
0.61 |
-8.26 |
-0.18 |
0 |
|
|
47762 |
10535182 |
1 |
NO3C8H13 |
AB3C8D13 |
-123.96 |
1.48 |
-10.09 |
0.37 |
0 |
|
|
47763 |
10535183 |
1 |
NO2C9H17 |
AB2C9D17 |
-106.04 |
2.59 |
-9.01 |
1.9 |
0 |
|
|
47764 |
10535184 |
1 |
NO2C9H17 |
AB2C9D17 |
-114.74 |
5.45 |
-9.98 |
0.84 |
0 |
|
|
47765 |
10535186 |
1 |
NO2C9H17 |
AB2C9D17 |
-101.0 |
1.11 |
-9.31 |
0.66 |
0 |
|
|
47766 |
10535187 |
1 |
NC12H13 |
AB12C13 |
109.18 |
1.09 |
-6.18 |
-1.95 |
0 |
|
|
47767 |
10535188 |
1 |
NC12H13 |
AB12C13 |
74.75 |
1.59 |
-8.85 |
0.38 |
0 |
|
|
47768 |
10535189 |
1 |
NOC10H21 |
ABC10D21 |
-81.02 |
2.72 |
-9.63 |
0.7 |
0 |
|
|
47769 |
10535190 |
1 |
ClNOC8H10 |
ABCD8E10 |
-31.9 |
2.21 |
-9.27 |
-0.35 |
0 |
|
|
47770 |
10535191 |
1 |
ClNC9H12 |
ABC9D12 |
-1.82 |
3.57 |
-9.27 |
0.05 |
0 |
|
|
47771 |
10535193 |
2 |
NO2C3H4 |
AB2C3D4 |
-80.49 |
3.7 |
-9.98 |
-0.95 |
0 |
|
|
47772 |
10535194 |
4 |
OC2H3 |
AB2C3 |
-171.89 |
2.37 |
-9.13 |
0.35 |
0 |
|
|
47773 |
10535195 |
1 |
O2H8C11 |
A2B8C11 |
-3.2 |
4.82 |
-8.78 |
-1.35 |
0 |
|
|
47774 |
10535196 |
1 |
ON2H8C10 |
AB2C8D10 |
47.82 |
3.54 |
-9.14 |
-0.94 |
0 |
|
|
47775 |
10535208 |
2 |
OC5H10 |
AB5C10 |
-108.04 |
1.24 |
-9.97 |
1.14 |
0 |
|
|
47776 |
10535209 |
2 |
OC5H10 |
AB5C10 |
-137.09 |
2.09 |
-10.05 |
2.71 |
0 |
|
|
47777 |
10535228 |
2 |
O2C4H7 |
A2B4C7 |
-178.35 |
2.67 |
-10.1 |
0.32 |
0 |
|
|
47778 |
10535234 |
3 |
OC3H6 |
AB3C6 |
-136.18 |
4.55 |
-10.07 |
1.43 |
0 |
|
|
47779 |
10535235 |
1 |
OC12H14 |
AB12C14 |
14.29 |
2.11 |
-9.6 |
0.14 |
0 |
|
|
47780 |
10535236 |
1 |
OC12H14 |
AB12C14 |
-1.94 |
3.01 |
-9.61 |
0.01 |
0 |
|
|
47781 |
10535245 |
1 |
C13H18 |
A13B18 |
5.14 |
0.92 |
-9.18 |
0.41 |
0 |
|
|
47783 |
10535262 |
2 |
O2C4H7 |
A2B4C7 |
-201.55 |
1.05 |
-10.97 |
0.72 |
0 |
|
|
47784 |
10535264 |
1 |
N2O2H8C9 |
A2B2C8D9 |
20.45 |
3.35 |
-9.72 |
-1.18 |
0 |
|
|
47785 |
10535271 |
1 |
O2C11H12 |
A2B11C12 |
-29.15 |
3.06 |
-9.7 |
0.04 |
0 |
|
|
47786 |
10535281 |
1 |
OC12H16 |
AB12C16 |
-44.64 |
1.27 |
-9.24 |
0.31 |
0 |
|
|
47787 |
10535282 |
1 |
OC12H16 |
AB12C16 |
-24.44 |
1.87 |
-9.46 |
0.3 |
0 |
|
|
47788 |
10535283 |
1 |
OC12H16 |
AB12C16 |
28.82 |
3.43 |
-9.86 |
-0.22 |
0 |
|
|
47789 |
10535289 |
1 |
C13H20 |
A13B20 |
-18.49 |
0.73 |
-9.04 |
0.61 |
0 |
|
|
47790 |
10535294 |
1 |
NO2C10H11 |
AB2C10D11 |
-48.76 |
1.14 |
-8.3 |
-0.19 |
0 |
|
|
47791 |
10535338 |
1 |
ON5C7H9 |
AB5C7D9 |
62.68 |
3.29 |
-9.66 |
-1.66 |
0 |
|
|
47792 |
10535341 |
1 |
NO2C10H13 |
AB2C10D13 |
-81.95 |
3.7 |
-8.75 |
0.25 |
0 |
|
|
47793 |
10535356 |
1 |
NSC10H13 |
ABC10D13 |
61.46 |
4.6 |
-9.32 |
-0.51 |
0 |
|
|
47794 |
10535358 |
1 |
ClNO2C7H14 |
ABC2D7E14 |
-136.46 |
2.26 |
-10.02 |
1.44 |
0 |
|
|
47795 |
10535359 |
1 |
NO2C7H13 |
AB2C7D13 |
-99.23 |
4.28 |
-9.4 |
2.17 |
0 |
|
|
47796 |
10535360 |
1 |
ClNO2C7H14 |
ABC2D7E14 |
-143.1 |
3.02 |
-10.25 |
0.14 |
0 |
|
|
47797 |
10535367 |
1 |
ON2C10H12 |
AB2C10D12 |
1.69 |
3.5 |
-9.07 |
-0.26 |
0 |
|
|
47798 |
10535369 |
1 |
O3C10H12 |
A3B10C12 |
-102.85 |
2.26 |
-10.33 |
-2.0 |
0 |
|
|
47799 |
10535382 |
1 |
O2C11H16 |
A2B11C16 |
-45.35 |
4.78 |
-10.03 |
0.66 |
0 |
|
|
47800 |
10535393 |
1 |
FNO3H4C8 |
ABC3D4E8 |
-137.01 |
6.13 |
-9.99 |
-1.62 |
0 |
|
|
47801 |
10535405 |
1 |
NOSC9H11 |
ABCD9E11 |
-6.69 |
3.71 |
-9.37 |
-0.78 |
0 |
|
|
47802 |
10535406 |
1 |
NOSC9H11 |
ABCD9E11 |
-24.11 |
1.79 |
-9.26 |
-0.21 |
0 |
|
|
47804 |
10535417 |
1 |
O4C9H10 |
A4B9C10 |
-77.0 |
3.5 |
-10.46 |
-0.05 |
0 |
|
|
47805 |
10535425 |
1 |
O3C10H14 |
A3B10C14 |
-147.73 |
5.95 |
-10.96 |
-0.16 |
0 |
|
|
47806 |
10535426 |
1 |
O3C10H14 |
A3B10C14 |
-108.2 |
5.44 |
-10.48 |
0.6 |
0 |
|
|
47807 |
10535435 |
1 |
O2C11H18 |
A2B11C18 |
-77.98 |
4.72 |
-10.79 |
0.62 |
0 |
|
|
47808 |
10535436 |
1 |
O2C11H18 |
A2B11C18 |
-115.53 |
3.03 |
-9.54 |
0.9 |
0 |
|
|
47809 |
10535439 |
1 |
O2C11H18 |
A2B11C18 |
-64.46 |
1.09 |
-9.82 |
0.33 |
0 |
|
|
47810 |
10535440 |
1 |
O2C11H18 |
A2B11C18 |
-66.32 |
1.19 |
-9.74 |
0.36 |
0 |
|
|
47811 |
10535443 |
1 |
O2C11H18 |
A2B11C18 |
-79.6 |
1.09 |
-9.73 |
1.75 |
0 |
|
|
47813 |
10535449 |
1 |
OC12H22 |
AB12C22 |
-56.72 |
0.9 |
-8.86 |
1.38 |
0 |
|
|
47814 |
10535458 |
1 |
NO4C8H9 |
AB4C8D9 |
-125.4 |
3.55 |
-9.68 |
-0.18 |
0 |
|
|
47815 |
10535460 |
1 |
NO3C9H13 |
AB3C9D13 |
-103.76 |
3.73 |
-10.45 |
-0.45 |
0 |
|
|
47817 |
10535469 |
1 |
N5C8H17 |
A5B8C17 |
41.46 |
3.89 |
-8.73 |
0.85 |
0 |
|
|
47818 |
10535471 |
1 |
NOC11H21 |
ABC11D21 |
-75.12 |
3.15 |
-8.62 |
2.61 |
0 |
|
|
47819 |
10535472 |
1 |
NOC11H21 |
ABC11D21 |
-61.51 |
1.39 |
-9.62 |
1.3 |
0 |
|
|
47820 |
10535473 |
1 |
PC4O6H9 |
AB4C6D9 |
-315.01 |
3.99 |
-10.87 |
0.41 |
0 |
|
|
47821 |
10535474 |
1 |
O3N4C6H6 |
A3B4C6D6 |
-67.54 |
0.02 |
-10.69 |
-1.48 |
0 |
|
|
47822 |
10535481 |
1 |
SO3C8H8 |
AB3C8D8 |
-86.42 |
1.82 |
-9.48 |
-0.7 |
0 |
|
|
47823 |
10535491 |
1 |
N2O2C9H16 |
A2B2C9D16 |
-61.48 |
3.45 |
-8.9 |
0.56 |
0 |
|
|
47824 |
10535499 |
1 |
O2C11H20 |
A2B11C20 |
-124.73 |
5.51 |
-10.48 |
0.95 |
0 |
|
|
47825 |
10535500 |
1 |
O2C11H20 |
A2B11C20 |
-110.19 |
4.29 |
-10.22 |
-0.32 |
0 |
|
|
47826 |
10535502 |
1 |
O2C11H20 |
A2B11C20 |
-131.15 |
1.93 |
-10.67 |
0.88 |
0 |
|
|
47827 |
10535503 |
1 |
O2C11H20 |
A2B11C20 |
-133.35 |
1.16 |
-9.86 |
2.68 |
0 |
|
|
47828 |
10535504 |
2 |
C7H8 |
A7B8 |
30.02 |
1.18 |
-8.94 |
0.01 |
0 |
|
|
47829 |
10535505 |
1 |
ON2C10H20 |
AB2C10D20 |
-61.1 |
2.43 |
-8.82 |
2.55 |
0 |
|
|
47830 |
10535515 |
1 |
ClOC10H13 |
ABC10D13 |
-48.3 |
2.09 |
-9.7 |
0.05 |
0 |